2-(5-chloro-1-methylimidazol-2-yl)phenol

C10H9ClN2O — CID 137000627

IUPAC2-(5-chloro-1-methylimidazol-2-yl)phenol
SMILESCn1c(Cl)cnc1-c1ccccc1O
InChIInChI=1S/C10H9ClN2O/c1-13-9(11)6-12-10(13)7-4-2-3-5-8(7)14/h2-6,14H,1H3
InChIKeyPOFLYPZOZBBLOO-UHFFFAOYSA-N
MW208.65 g/mol
LogP2.45
Rot. Bonds1

About 2-(5-chloro-1-methylimidazol-2-yl)phenol

2-(5-chloro-1-methylimidazol-2-yl)phenol (PubChem CID 137000627) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is 2-(5-chloro-1-methylimidazol-2-yl)phenol.

Molecular Properties

Compound Name2-(5-chloro-1-methylimidazol-2-yl)phenol
PubChem CID137000627
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name2-(5-chloro-1-methylimidazol-2-yl)phenol
SMILESCn1c(Cl)cnc1-c1ccccc1O
InChIInChI=1S/C10H9ClN2O/c1-13-9(11)6-12-10(13)7-4-2-3-5-8(7)14/h2-6,14H,1H3
InChIKeyPOFLYPZOZBBLOO-UHFFFAOYSA-N
XLogP2.45
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-Hydroxybenzyl)imidazole
CID 193822
2-(3-Benzylimidazol-4-yl)phenol
CID 2806275
2-[1-(1H-imidazol-1-yl)vinyl]phenol
CID 2805536
Phenol, 2-[1-[[3-(1H-imidazol-1-yl)propyl]imino]ethyl]-
CID 136448550
2,6-Ditert-butyl-4-[(2-methylimidazol-1-yl)methyl]phenol
CID 12229402
3-{1-[methyl({[1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl]methyl})amino]ethyl}phenol
CID 56787422
4-[2-(3-Decyl-2-methylimidazol-3-ium-1-yl)ethyl]phenol bromide
CID 168278922
4-[2-(3-Benzyl-2-methylimidazol-3-ium-1-yl)ethyl]phenol bromide
CID 168279533
4-Chloro-2-(3-cyclohexylimidazol-4-yl)phenol
CID 70925897
4-[2-(3-Methylimidazol-3-ium-1-yl)ethyl]phenol chloride
CID 13948308
2-(2-Amino-1-pentylimidazol-4-yl)phenol;hydrochloride
CID 162673768
4-(2-Aminomethyl-imidazol-1-ylmethyl)-phenol
CID 13477994

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1-methylimidazol-2-yl)phenol?
The IUPAC name of 2-(5-chloro-1-methylimidazol-2-yl)phenol (CID 137000627) is 2-(5-chloro-1-methylimidazol-2-yl)phenol.
What is the SMILES notation for 2-(5-chloro-1-methylimidazol-2-yl)phenol?
The canonical SMILES for 2-(5-chloro-1-methylimidazol-2-yl)phenol is Cn1c(Cl)cnc1-c1ccccc1O.
What is the InChIKey of 2-(5-chloro-1-methylimidazol-2-yl)phenol?
The InChIKey is POFLYPZOZBBLOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c1-13-9(11)6-12-10(13)7-4-2-3-5-8(7)14/h2-6,14H,1H3.
What are the key properties of 2-(5-chloro-1-methylimidazol-2-yl)phenol?
2-(5-chloro-1-methylimidazol-2-yl)phenol has a molecular weight of 208.65 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1-methylimidazol-2-yl)phenol is sourced from PubChem (CID 137000627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).